Compound Identification
SMILES
CCN(CCCCC(O)=O)C1=C(CN(CC2=CC(=CC(=C2)C#N)C(F)(F)F)C2=CC(C)=NO2)C=C2CCCC2=C1
InChIKey
InChIKey=BZKGJVUXJILCAY-UHFFFAOYSA-N
Formula
C30H33F3N4O3
Mass
554.614
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
Indanes Benzonitriles Benzylamines Dialkylarylamines Heteroaromatic compounds Isoxazoles Amino acids Nitriles Carboxylic acids Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Alkyl fluorides Organic oxides Carbonyl compounds Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Indane - Benzonitrile - Benzylamine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Azole - Isoxazole - Heteroaromatic compound - Amino acid or derivatives - Amino acid - Tertiary amine - Organoheterocyclic compound - Azacycle - Carboxylic acid - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Nitrile - Carbonitrile - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors
Not available